2-(3-bromanyl-4-ethoxy-phenyl)-3-methyl-butanoic acid

Systemtic Name: 2-(3-bromanyl-4-ethoxy-phenyl)-3-methyl-butanoic acid Openeye Name: 2-(3-bromo-4-ethoxy-phenyl)-3-methyl-butanoic acid CAS Name: 2-(3-bromo-4-ethoxyphenyl)-3-methylbutanoic acid IUPAC Name: 2-(3-bromo-4-ethoxyphenyl)-3-methylbutanoic acid Traditional Name: 2-(3-bromo-4-ethoxy-phenyl)-3-methyl-butyric acid Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C(C)C)C(=O)O)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C(C)C)C(=O)O)Br

InChI

InChI=1S/C13H17BrO3/c1-4-17-11-6-5-9(7-10(11)14)12(8(2)3)13(15)16/h5-8,12H,4H2,1-3H3,(H,15,16)